Clausine D

Base Information

• Chemical Name: Clausine D
• CAS No.: 142846-95-5
• Molecular Formula: C18H17 N O2
• Molecular Weight: 279.33
• DSSTox Substance ID: DTXSID70162200
• Nikkaji Number: J490.263G
• Wikidata: Q72461046
• Metabolomics Workbench ID: 126323
• ChEMBL ID: CHEMBL2036044
• Mol file: 142846-95-5.mol

Synonyms:clausine D;clausine-D

Chemical Property of Clausine D

Chemical Property:

• Vapor Pressure: 2.21E-11mmHg at 25°C
• Boiling Point: 518.8°Cat760mmHg
• Flash Point: 267.5°C
• PSA: 53.09000
• Density: 1.259g/cm³
• LogP: 4.34790
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 279.125928785
• Heavy Atom Count: 21
• Complexity: 415

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCC1=C2C3=CC=CC=C3NC2=C(C=C1C=O)O)C